Home Halogens tert-Butyl 2-(5-bromopyrimidin-2-yl)acetate

tert-Butyl 2-(5-bromopyrimidin-2-yl)acetate

CAS No.:
1114830-16-8
Catalog Number:
AG00HC5W
Molecular Formula:
C10H13BrN2O2
Molecular Weight:
273.1264
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Product Description
Catalog Number:
AG00HC5W
Chemical Name:
tert-Butyl 2-(5-bromopyrimidin-2-yl)acetate
CAS Number:
1114830-16-8
Molecular Formula:
C10H13BrN2O2
Molecular Weight:
273.1264
MDL Number:
MFCD16036588
IUPAC Name:
tert-butyl 2-(5-bromopyrimidin-2-yl)acetate
InChI:
InChI=1S/C10H13BrN2O2/c1-10(2,3)15-9(14)4-8-12-5-7(11)6-13-8/h5-6H,4H2,1-3H3
InChI Key:
XSBAGLHOIWJHJW-UHFFFAOYSA-N
SMILES:
O=C(Cc1ncc(cn1)Br)OC(C)(C)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.016g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.13g/mol
Monoisotopic Mass:
272.016g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties